%chk=000051057.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051057

0 1
 N  -0.8195000      0.2180000      0.2232000    
 N    3.780400      0.8721000      0.2357000    
 C   0.2789000     -0.5930000      0.3981000    
 C    1.576000     -7.5599998E-02  0.8905000    
 C  -6.8300001E-02  -1.878500      4.2100001E-02
 C   -1.871700     -0.5613000     -0.2478000    
 C   -1.424500      -1.859900     -0.3654000    
 C    2.493600      0.3911000     -0.2554000    
 C  -0.9324000       1.588800      0.4565000    
 C   0.8089000      -3.066000      7.5900003E-02
 C   -3.113300      9.2299998E-02 -0.4973000    
 C   -2.104500       2.199900      0.2199000    
 C   -3.224900       1.415700     -0.2734000    
 C    4.621200       1.256500     -0.9024000    
 H    1.436200      0.7337000       1.616600    
 H    2.087300     -0.8712000       1.449400    
 H   -2.013400      -2.700200     -0.7080000    
 H    1.988900       1.190800     -0.8122000    
 H    2.645300     -0.4433000     -0.9527000    
 H  -7.1300000E-02   2.136000      0.8176000    
 H    1.116300      -3.289000       1.102700    
 H   0.2991000      -3.950300     -0.3204000    
 H    1.708300      -2.902400     -0.5264000    
 H   -3.957500     -0.4805000     -0.8655000    
 H    4.244800      0.1311000      0.7600000    
 H   -2.239100       3.262200      0.3831000    
 H   -4.160500       1.932700     -0.4570000    
 H    5.583400       1.622400     -0.5309000    
 H    4.161000       2.065600      -1.478900    
 H    4.816700      0.4059000      -1.563500    


%chk=000051057-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051057

0 1
N -0.775221 0.176898 0.194069
N 3.777503 0.909978 0.184779
C 0.297420 -0.701930 0.394521
C 1.654944 -0.221711 0.822341
C -0.160604 -2.008353 0.092514
C -1.930015 -0.573899 -0.234445
C -1.533397 -1.928433 -0.293749
C 2.508218 0.365356 -0.335100
C -0.835965 1.559719 0.361800
C 0.672822 -3.264093 0.180741
C -3.139096 0.136230 -0.482894
C -2.022494 2.234681 0.118109
C -3.195340 1.521518 -0.312380
C 4.639695 1.541754 -0.831250
H 1.583987 0.551087 1.614167
H 2.201931 -1.073147 1.272081
H -2.173599 -2.760489 -0.582590
H 1.955803 1.191916 -0.824194
H 2.649472 -0.423463 -1.116682
H 0.078908 2.057285 0.690596
H 1.011246 -3.460743 1.216433
H 0.092794 -4.142547 -0.149510
H 1.577676 -3.205213 -0.453725
H -4.016957 -0.430878 -0.807538
H 4.286692 0.210044 0.741429
H -2.048460 3.318857 0.257640
H -4.124020 2.067389 -0.503665
H 5.574819 1.893811 -0.360479
H 4.126014 2.426416 -1.251760
H 4.910622 0.875562 -1.687159


